4-tert-butyl-2-[6-[4-(trifluoromethyl)piperidin-1-yl]pyridin-1-ium-3-yl]-1,3-thiazole

Systemtic Name: 4-tert-butyl-2-[6-[4-(trifluoromethyl)piperidin-1-yl]pyridin-1-ium-3-yl]-1,3-thiazole Openeye Name: 4-tert-butyl-2-[6-[4-(trifluoromethyl)-1-piperidyl]pyridin-1-ium-3-yl]thiazole CAS Name: 4-tert-butyl-2-[6-[4-(trifluoromethyl)-1-piperidinyl]-3-pyridin-1-iumyl]thiazole IUPAC Name: 4-tert-butyl-2-[6-[4-(trifluoromethyl)piperidin-1-yl]pyridin-1-ium-3-yl]-1,3-thiazole Traditional Name: 4-tert-butyl-2-[6-[4-(trifluoromethyl)piperidino]pyridin-1-ium-3-yl]thiazole Formula: C18H23F3N3S+ MolecularWeight: 370.45553

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=C[NH+]=C(C=C2)N3CCC(CC3)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=C[NH+]=C(C=C2)N3CCC(CC3)C(F)(F)F

InChI

InChI=1S/C18H22F3N3S/c1-17(2,3)14-11-25-16(23-14)12-4-5-15(22-10-12)24-8-6-13(7-9-24)18(19,20)21/h4-5,10-11,13H,6-9H2,1-3H3/p+1